Products 1257544-85-6

CAS 1257544-85-6 is the registry number for Betamethasone Impurity 2 . Offered by: Chemat Brand. Available pack sizes: on request.

Betamethasone Impurity 2
Chemat Brand
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  • Variants: 1
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Structural formula: {0} (CAS {1})

2-[(8S,9R,10S,11S,13S,14S,16S,17R)-9-fluoro-11-hydroxy-10,13,16-trimethyl-3-oxo-7,8,11,12,14,15,16,17-octahydro-6H-cyclopenta[a]phenanthren-17-yl]-2-oxoacetic acid (CAS 1257544-85-6) is a chemical compound with the molecular formula C22H27FO5 and a molecular weight of 390.4 g/mol. IUPAC name: 2-[(8S,9R,10S,11S,13S,14S,16S,17R)-9-fluoro-11-hydroxy-10,13,16-trimethyl-3-oxo-7,8,11,12,14,15,16,17-octahydro-6H-cyclopenta[a]phenanthren-17-yl]-2-oxoacetic acid. InChIKey: CHLBNXRTRATBRL-VHFLKNLQSA-N.

Identity
Molecular formulaC22H27FO5
Molecular weight390.4 g/mol
IUPAC name2-[(8S,9R,10S,11S,13S,14S,16S,17R)-9-fluoro-11-hydroxy-10,13,16-trimethyl-3-oxo-7,8,11,12,14,15,16,17-octahydro-6H-cyclopenta[a]phenanthren-17-yl]-2-oxoacetic acid
InChIKeyCHLBNXRTRATBRL-VHFLKNLQSA-N
SMILESC[C@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@@]4([C@]3([C@H](C[C@@]2([C@@H]1C(=O)C(=O)O)C)O)F)C

Computed by PubChem (NCBI)

Synonyms: Betamethasone Impurity 107
Isomers (same molecular formula)
8-fluoro-14-hydroxy-14-(2-hydroxyacetyl)-2,13,15-trimethyl-18-oxapentacyclo[8.8.0.01,17.02,7.011,15]octadeca-3,6-dien-5-one C22H27FO5
2-[(8S,9S,10S,11S,13S,14R,16S,17S)-9-fluoro-11,17-dihydroxy-10,13,16-trimethyl-3-oxo-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-17-yl]-2-oxoacetaldehyde C22H27FO5
(8S,9R,10S,11S,13S,14S,17R)-9-fluoro-11,17-dihydroxy-17-(2-hydroxyacetyl)-10,13-dimethyl-16-methylidene-7,8,11,12,14,15-hexahydro-6H-cyclopenta[a]phenanthren-3-one C22H27FO5
(8S,9R,10S,13S,14S,16S,17R)-9-fluoro-17-hydroxy-17-(2-hydroxyacetyl)-10,13,16-trimethyl-7,8,12,14,15,16-hexahydro-6H-cyclopenta[a]phenanthrene-3,11-dione C22H27FO5
(8S,9R,10S,13S,14S,16R,17R)-9-fluoro-17-hydroxy-17-(2-hydroxyacetyl)-10,13,16-trimethyl-7,8,12,14,15,16-hexahydro-6H-cyclopenta[a]phenanthrene-3,11-dione C22H27FO5